2-(7,8-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: 2-(7,8-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: 2-(7,8-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid CAS Name: 2-(7,8-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid IUPAC Name: 2-(7,8-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid Traditional Name: 2-(3-keto-7,8-dimethyl-1,4-benzoxazin-4-yl)acetic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N(C(=O)CO2)CC(=O)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)N(C(=O)CO2)CC(=O)O)C

InChI

InChI=1S/C12H13NO4/c1-7-3-4-9-12(8(7)2)17-6-10(14)13(9)5-11(15)16/h3-4H,5-6H2,1-2H3,(H,15,16)